N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)propanamide

C13H15N3O3 — CID 47099545

IUPACN-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)propanamide
SMILESCCC(=O)NN1C(=O)NC(C)(c2ccccc2)C1=O
InChIInChI=1S/C13H15N3O3/c1-3-10(17)15-16-11(18)13(2,14-12(16)19)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3,(H,14,19)(H,15,17)
InChIKeyYWYMAIAKAHAUMS-UHFFFAOYSA-N
MW261.28 g/mol
LogP0.89
Rot. Bonds3

About N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)propanamide

N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)propanamide (PubChem CID 47099545) has the molecular formula C13H15N3O3 and a molecular weight of 261.28 g/mol. Its IUPAC name is N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)propanamide.

Molecular Properties

Compound NameN-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)propanamide
PubChem CID47099545
Molecular FormulaC13H15N3O3
Molecular Weight261.28 g/mol
Exact Mass261.11
IUPAC NameN-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)propanamide
SMILESCCC(=O)NN1C(=O)NC(C)(c2ccccc2)C1=O
InChIInChI=1S/C13H15N3O3/c1-3-10(17)15-16-11(18)13(2,14-12(16)19)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3,(H,14,19)(H,15,17)
InChIKeyYWYMAIAKAHAUMS-UHFFFAOYSA-N
XLogP0.89
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

Analyze N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)amino]-6-oxohexanoic acid
CID 167859701
N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-3,3-diphenylpropanamide
CID 84861647
2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 8694880
2-[(4-ethylphenyl)methyl-methylamino]-N-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 8794419
methyl-[2-[[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]amino]-2-oxoethyl]-[2-oxo-2-(propan-2-ylamino)ethyl]azanium
CID 8913046
N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide
CID 55450886
N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N',N'-dipropylpentanediamide
CID 56546213
4-(2-ethoxyphenoxy)-N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]butanamide
CID 8879377
2-(4-fluorophenoxy)-N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
CID 17439522
[2-(dimethylamino)-2-oxoethyl]-methyl-[2-[[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]amino]-2-oxoethyl]azanium
CID 8694883
2-(2-chlorophenoxy)-N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
CID 55342591
2-(3,4-dimethylphenyl)sulfanyl-N-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 29318902

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)propanamide?
The IUPAC name of N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)propanamide (CID 47099545) is N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)propanamide.
What is the SMILES notation for N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)propanamide?
The canonical SMILES for N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)propanamide is CCC(=O)NN1C(=O)NC(C)(c2ccccc2)C1=O.
What is the InChIKey of N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)propanamide?
The InChIKey is YWYMAIAKAHAUMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3/c1-3-10(17)15-16-11(18)13(2,14-12(16)19)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3,(H,14,19)(H,15,17).
What are the key properties of N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)propanamide?
N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)propanamide has a molecular weight of 261.28 g/mol, XLogP of 0.89, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)propanamide is sourced from PubChem (CID 47099545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).